ChemSpider 2D Image | N-(2,2-Difluoro-1,3-benzodioxol-5-yl)-3-(1-isobutyl-3,5-dimethyl-1H-pyrazol-4-yl)propanamide | C19H23F2N3O3

N-(2,2-Difluoro-1,3-benzodioxol-5-yl)-3-(1-isobutyl-3,5-dimethyl-1H-pyrazol-4-yl)propanamide

  • Molecular FormulaC19H23F2N3O3
  • Average mass379.401 Da
  • Monoisotopic mass379.170746 Da
  • ChemSpider ID22062677

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1H-Pyrazole-4-propanamide, N-(2,2-difluoro-1,3-benzodioxol-5-yl)-3,5-dimethyl-1-(2-methylpropyl)- [ACD/Index Name]
N-(2,2-Difluor-1,3-benzodioxol-5-yl)-3-(1-isobutyl-3,5-dimethyl-1H-pyrazol-4-yl)propanamid [German] [ACD/IUPAC Name]
N-(2,2-Difluoro-1,3-benzodioxol-5-yl)-3-(1-isobutyl-3,5-dimethyl-1H-pyrazol-4-yl)propanamide [ACD/IUPAC Name]
N-(2,2-Difluoro-1,3-benzodioxol-5-yl)-3-(1-isobutyl-3,5-diméthyl-1H-pyrazol-4-yl)propanamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 507.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.7±3.0 kJ/mol
Flash Point: 260.5±30.1 °C
Index of Refraction: 1.572
Molar Refractivity: 95.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.01
ACD/LogD (pH 5.5): 3.87
ACD/BCF (pH 5.5): 516.85
ACD/KOC (pH 5.5): 3040.12
ACD/LogD (pH 7.4): 3.88
ACD/BCF (pH 7.4): 520.75
ACD/KOC (pH 7.4): 3063.05
Polar Surface Area: 65 Å2
Polarizability: 37.9±0.5 10-24cm3
Surface Tension: 38.8±7.0 dyne/cm
Molar Volume: 291.0±7.0 cm3

Click to predict properties on the Chemicalize site


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